| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 21 | Yes |
Popular Name: [2-(3,4-Dimethoxy-phenyl)-ethyl]-(4-fluoro-benzyl)-amine [2-(3,4-Dimethoxy-phenyl)-ethyl]…
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CAS Numbers: 353779-44-9 , 435341-91-6 , [353779-44-9]
2-(3,4-dimethoxyphenyl)-N-(4-fluorobenzyl)ethanamine
DIMETHOXYPHENYLETHYLFLUOROBENZYLAMIN
DIMETHOXYPHENYLETHYLFLUOROBENZYLAMINEHYDROCHLORID
[2-(3,4-Dimethoxy-phenyl)-ethyl]-(4-fluoro-benzyl)
[2-(3,4-Dimethoxy-phenyl)-ethyl]-(4-fluoro-benzyl) -amine
[2-(3,4-Dimethoxyphenyl)-ethyl]-(4-fluoro-benzyl)-amine hydrochloride
[2-(3,4-dimethoxyphenyl)-ethyl]-(4-fluoro-benzyl)-aminehydrochloride
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.11 | 8.3 | -56.03 | 2 | 3 | 1 | 35 | 290.358 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.11 | 6.94 | -7.82 | 1 | 3 | 0 | 30 | 289.35 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.